AH22541
68719-87-9 | Dimethyl 2-(5-nitropyridin-2-yl)malonate
Manufacturer: A2B Chem
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CatalogNumber
AH22541
ChemicalName
Dimethyl 2-(5-nitropyridin-2-yl)malonate
CasNumber
68719-87-9
MolecularFormula
C10H10N2O6
MolecularWeight
254.1962
MdlNumber
MFCD03425824
Smiles
COC(=O)C(c1ccc(cn1)[N+](=O)[O-])C(=O)OC
Complexity
324
Covalently-bondedUnitCount
1
HeavyAtomCount
18
HydrogenBondAcceptorCount
7
RotatableBondCount
5
Xlogp3
0.6
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CatalogNumber: AH22541
ChemicalName: Dimethyl 2-(5-nitropyridin-2-yl)malonate
CasNumber: 68719-87-9
MolecularFormula: C10H10N2O6
MolecularWeight: 254.1962
MdlNumber: MFCD03425824
Smiles: COC(=O)C(c1ccc(cn1)[N+](=O)[O-])C(=O)OC
Complexity: 324
Covalently-bondedUnitCount: 1
HeavyAtomCount: 18
HydrogenBondAcceptorCount: 7
RotatableBondCount: 5
Xlogp3: 0.6
CatalogNumber:
AH22541
ChemicalName:
Dimethyl 2-(5-nitropyridin-2-yl)malonate
CasNumber:
68719-87-9
MolecularFormula:
C10H10N2O6
MolecularWeight:
254.1962
MdlNumber:
MFCD03425824
Smiles:
COC(=O)C(c1ccc(cn1)[N+](=O)[O-])C(=O)OC
Complexity:
324
Covalently-bondedUnitCount:
1
HeavyAtomCount:
18
HydrogenBondAcceptorCount:
7
RotatableBondCount:
5
Xlogp3:
0.6
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Smiles: COc1ccc2c(c1)CCCC2CC(=O)O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
COc1ccc2c(c1)CCCC2CC(=O)O
Complexity:
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__
HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC(=CC=C3)C(=O)O
Complexity: __
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Smiles:
C1=CC=C(C=C1)NC2=NC=CC(=N2)C3=CC(=CC=C3)C(=O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Smiles: CN1CCN(CC1C)C(=O)OC(C)(C)C
Complexity: __
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HydrogenBondAcceptorCount: __
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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Smiles:
CN1CCN(CC1C)C(=O)OC(C)(C)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
RotatableBondCount:
__
Xlogp3:
__